Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 5/20 | 0.52 |
| ▸ | CTSL | P07711 | 2/20 | 0.52 |
| ▸ | CTSB | P07858 | 2/20 | 0.52 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15311168 | 0.85 | CTSK (0.49) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL14716956 | 0.85 | CTSK (0.49) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL27794800 | 0.85 | CTSK (0.49) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL27812309 | 0.83 | CTSK (0.48) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL28516412 | 0.82 | CTSL (0.53) | CTSKCTSLCTSBOPRM1 | |
| SCHEMBL29060746 | 0.82 | CTSK (0.47) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL28404852 | 0.79 | CTSK (0.45) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL28406317 | 0.78 | CTSK (0.44) | CTSKCTSLCTSBSCN9AOPRK1 | |
| SCHEMBL28434896 | 0.77 | CTSK (0.43) | CTSKCTSLCTSBSCN9ANPC1 | |
| SCHEMBL28404682 | 0.77 | CTSK (0.43) | CTSKCTSLCTSBSCN9ANPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112312902-B | Pd (II) -catalyzed enantioselective C-H arylation of free carboxylic acids | 斯克里普斯研究学院 | 2022-02-18 | — | — | CN | disclosed |
| CN-112312902-A | Pd (II) -catalyzed enantioselective C-H arylation of free carboxylic acids | 斯克里普斯研究学院 | 2021-02-02 | — | — | CN | disclosed |